(Chloromethyl)boronic Acid Pinacol Ester - CAS 83622-42-8

Catalog:	BB037065
Product Name:	(Chloromethyl)boronic Acid Pinacol Ester
CAS:	83622-42-8
Synonyms:	2-(chloromethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(chloromethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Technical Data

Patents

Computed Properties

IUPAC Name:	2-(chloromethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Description:	(Chloromethyl)boronic Acid Pinacol Ester (CAS# 83622-42-8) is a useful research chemical.
Molecular Weight:	176.45
Molecular Formula:	C7H14ClO2B
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)CCl
InChI:	InChI=1S/C7H14BClO2/c1-6(2)7(3,4)11-8(5-9)10-6/h5H2,1-4H3
InChI Key:	ABFNBZSUTILCRK-UHFFFAOYSA-N
LogP:	2.27490

Publication Number	Title	Priority Date
CN-111253824-A	Environment-friendly powder coating with zero VOC (volatile organic compounds) emission	20200224
CN-111117555-A	Environment-friendly aqueous adhesive and preparation method thereof	20191230
US-2020108083-A1	Boron Containing PDE4 Inhibitors	20181005
WO-2020070651-A1	Boron containing pde4 inhibitors	20181005
US-10946031-B2	PDE4 inhibitor (R)-4-(5-(4-methoxy-3-propoxyphenyl)pyridin-3-yl)-1,2-oxaborolan-2-ol	20181005

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Related Functional Groups

Boronic Acids and Esters

[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[1256355-43-7]
2-(Methoxycarbonyl)-4-methylphenylboronic Acid
[1219956-23-6]
2,4-Diphenyl-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine
[871126-22-6]
2-Fluoro-4-formylphenylboronic acid
[355836-10-1]
2-Methoxy-4-(trifluoromethoxy)phenylboronic Acid
[364044-44-0]
4'-Chloro-4-biphenylboronic Acid

Complexity:	143
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	176.0775375
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	176.0775375
Rotatable Bond Count:	1
Topological Polar Surface Area:	18.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0